N-Boc-L-Adamantylglycine
N-Boc-L-Adamantylglycine structure
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Common Name | N-Boc-L-Adamantylglycine | ||
|---|---|---|---|---|
| CAS Number | 361441-97-6 | Molecular Weight | 309.401 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 460.3±28.0 °C at 760 mmHg | |
| Molecular Formula | C17H27NO4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 232.2±24.0 °C | |
Summary: N-叔丁氧羰基-L-金刚烷基甘氨酸, also known as N-Boc-L-Adamantylglycine, with chemical name (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid, CAS number 361441-97-6, molecular formula C17H27NO4, molecular weight 309.401. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 460.3±28.0 °C at 760 mmHg |
| Molecular Formula | C17H27NO4 |
| Molecular Weight | 309.401 |
| Flash Point | 232.2±24.0 °C |
| Exact Mass | 309.194000 |
| PSA | 79.12000 |
| LogP | 3.98 |
| Vapour Pressure | 0.0±2.4 mmHg at 25°C |
| Index of Refraction | 1.540 |
| InChIKey | LJUATQZYDYSZPV-CQCMJFKXSA-N |
| SMILES | CC(C)(C)OC(=O)NC(C(=O)O)C12CC3CC(CC(C3)C1)C2 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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Material Safety Data Sheet
Section1. Identification of the substance Product Name: N-Boc-L-adamantylglycine Synonyms: Section2. Hazards identification Harmful by inhalation, in contact with skin, and if swallowed. Section3. Composition/information on ingredients. Ingredient name:N-Boc-L-adamantylglycine CAS number:361441-97-6 Section4. First aid measures Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing contaminated clothing and shoes. If irritation persists, seek medical attention. Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical attention. Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention. Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention. Section5. Fire fighting measures In the event of a fire involving this material, alone or in combination with other materials, use dry powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus should be worn. Section6. Accidental release measures Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national standards. Respiratory precaution:Wear approved mask/respirator Hand precaution:Wear suitable gloves/gauntlets Skin protection:Wear suitable protective clothing Eye protection:Wear suitable eye protection Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container for disposal. See section 12. Environmental precautions: Do not allow material to enter drains or water courses. Section7. Handling and storage Handling:This product should be handled only by, or under the close supervision of, those properly qualified in the handling and use of potentially hazardous chemicals, who should take into account the fire, health and chemical hazard data given on this sheet. Store in closed vessels, refrigerated. Storage: Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data No data Melting point: Flash point:No data Density:No data Molecular formula:C17H27NO4 Molecular weight:309.4 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides. Section11. Toxicological information No data. Section12. Ecological information No data. Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2924199090 |
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This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 4 | |
CAS#:24424-99-5
CAS#:102502-64-7
CAS#:361441-95-4
CAS#:2094-74-8
CAS#:770-71-8
CAS#:828-51-3
CAS#:711-01-3
CAS#:95853-35-3
CAS#:361442-00-4![(2S)-2-[(3R,5S)-3,5-dihydroxy-1-adamantyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid structure](https://image.chemsrc.com/caspic/174/681282-72-4.png)
CAS#:681282-72-4![tert-butyl N-[(1S)-2-[(1S,3S,5S)-3-carbamoyl-2-azabicyclo[3.1.0]hexan-2-yl]-1-(3-hydroxy-1-adamantyl)-2-oxoethyl]carbamate structure](https://image.chemsrc.com/caspic/118/361442-01-5.png)
CAS#:361442-01-5![N-[(1S)-2-[(1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)-2-oxoethyl]carbamic acid 1,1-dimethylethyl ester structure](https://image.chemsrc.com/caspic/495/709031-43-6.png)
CAS#:709031-43-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2924199090 |
|---|---|
| Summary | 2924199090. other acyclic amides (including acyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (2S)-(3R,5R,7R)-Adamantan-1-yl({[(2-methyl-2-propanyl)oxy]carbonyl}amino)acetic acid |
| TRI018 |
| N-Boc-L-Adamantylglycine |
| (S)-N-Boc-adamantylglycine |
| (|AS)-|A-[[(tert-Butoxy)carbonyl]amino]tricyclo[3.3.1.13,7]decane-1-acetic acid |
| N-Boc-AdGly |
| (S)-N-(tert-butoxycarbonylamino)-1-adamantylglycine |
| (2S)-2-(Adamantan-1-yl)-2-((tert-butoxycarbonyl)amino)acetic acid |
| (2S)-Adamantan-1-yl({[(2-methyl-2-propanyl)oxy]carbonyl}amino)acetic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: CAS number of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is 361441-97-6. |
| Q: What is the English name of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: The English name of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid. |
| Q: What is the molecular weight of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: Molecular weight of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is 309.401. |
| Q: What are the downstream products of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: Related downstream products(CAS) of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid: 361442-00-4;681282-72-4;361442-01-5;709031-43-6. |
| Q: What is the polar surface area (PSA) of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: Polar surface area (PSA) of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is 79.12000. |
| Q: What is the InChIKey of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: InChIKey of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is LJUATQZYDYSZPV-CQCMJFKXSA-N. |
| Q: What is the SMILES notation of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: SMILES notation of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is CC(C)(C)OC(=O)NC(C(=O)O)C12CC3CC(CC(C3)C1)C2. |
| Q: What is the LogP of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: LogP of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is 3.98. |
| Q: What are the upstream materials of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: Related upstream materials(CAS) of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid: 24424-99-5;102502-64-7;361441-95-4;2094-74-8;770-71-8;828-51-3;711-01-3;95853-35-3. |
| Q: What is the boiling point of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid? |
| A: Boiling point of (2S)-2-(1-adamantyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid is 460.3±28.0 °C at 760 mmHg. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |